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Benzenebutanoic acid, .gamma.-[(phenylmethylene)amino]-, methyl ester, (.+-.)-
SpectraBase Compound ID BJbRKEo1XGX
InChI InChI=1S/C18H19NO2/c1-21-18(20)13-12-17(16-10-6-3-7-11-16)19-14-15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3/b19-14+
InChIKey YBBFUNMXFUSKLC-XMHGGMMESA-N
Mol Weight 281.36 g/mol
Molecular Formula C18H19NO2
Exact Mass 281.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATxTrDG0UZl
Name Benzenebutanoic acid, .gamma.-[(phenylmethylene)amino]-, methyl ester, (.+-.)-
CAS Registry Number 119993-28-1
Comments Less than 3 mono-isotopic peaks
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Formula C18H19NO2
InChI InChI=1S/C18H19NO2/c1-21-18(20)13-12-17(16-10-6-3-7-11-16)19-14-15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3/b19-14+
InChIKey YBBFUNMXFUSKLC-XMHGGMMESA-N
Molecular Weight 281.355 g/mol
SMILES c1(\C=N\C(CCC(=O)OC)c2ccccc2)ccccc1
SPLASH splash10-0007-0900000000-346eeb7be3f03ccfab06
Source of Spectrum F-44-5371-15
Synonyms methyl 4-phenyl-4-{[(E)-phenylmethylidene]amino}butanoate Methyl N-benzylidene-4-amino-4-phenylbutyrate
Wiley ID 1285054